2-chloranyl-3-(octadecylamino)naphthalene-1,4-dione

Systemtic Name: 2-chloranyl-3-(octadecylamino)naphthalene-1,4-dione Openeye Name: 2-chloro-3-(octadecylamino)naphthalene-1,4-dione CAS Name: 2-chloro-3-(octadecylamino)naphthalene-1,4-dione IUPAC Name: 2-chloro-3-(octadecylamino)naphthalene-1,4-dione Traditional Name: 2-chloro-3-(stearylamino)-1,4-naphthoquinone Formula: C28H42ClNO2 MolecularWeight: 460.09158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC1=C(C(=O)C2=CC=CC=C2C1=O)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC1=C(C(=O)C2=CC=CC=C2C1=O)Cl

InChI

InChI=1S/C28H42ClNO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-30-26-25(29)27(31)23-20-17-18-21-24(23)28(26)32/h17-18,20-21,30H,2-16,19,22H2,1H3